SCHEMBL4387307

SCHEMBL4387307

COCOc1cc(CC(=O)OC)c(-c2ccc(CCC(O)c3ccccc3)o2)c(OCOC)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
HDAC1 Q13547 1/20 0.32
MCHR1 Q99705 1/20 0.31
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 2/20 0.30
TSHR P16473 1/20 0.30
PKM P14618 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5491747 0.88 HDAC3 (0.32) ALDH1A1KDM4EHSD17B10HDAC1MAPT
SCHEMBL4386950 0.84 ALDH1A1 (0.37) ALDH1A1KDM4EHSD17B10MEN1KMT2A
SCHEMBL4387636 0.82 ALDH1A1 (0.35) ALDH1A1KDM4EHSD17B10HDAC1POLB
SCHEMBL4379079 0.82 ALDH1A1 (0.36) ALDH1A1KDM4EHSD17B10MEN1KMT2A
SCHEMBL4379012 0.81 HDAC3 (0.34) ALDH1A1KDM4EHSD17B10HDAC1MAPT
SCHEMBL4390435 0.80 KDM4E (0.39) ALDH1A1KDM4EHSD17B10MEN1KMT2A
SCHEMBL4392083 0.79 ALDH1A1 (0.33) ALDH1A1KDM4EMEN1KMT2AHDAC1
SCHEMBL4392091 0.79 ALDH1A1 (0.33) ALDH1A1KDM4EMEN1KMT2AHDAC1
SCHEMBL4382486 0.79 MTNR1A (0.34) ALDH1A1KDM4EHDAC1
SCHEMBL4384034 0.79 ALDH1A1 (0.35) ALDH1A1KDM4EHSD17B10KMT2APPARG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P ALDH1A1 3520/4885KDM4E 3223/4885HSD17B10 405/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.